Benchmarking Study on Calculation of Specific Optical Rotation of Rigid Chiral Molecules in Solution: 1:1 Solute-Solvent Complex with PCM Solvation Model

2021 ◽  
pp. 113549
Author(s):  
Jiyoung Heo
Keyword(s):  
Optical Rotation ◽  
Chiral Molecules ◽  
Solvation Model ◽  
Specific Optical Rotation ◽  
Solvent Complex

Continuous-Wave Cavity-Enhanced Polarimetry for Optical Rotation Measurement of Chiral Molecules

2021 ◽  
Vol 93 (13) ◽  
pp. 5403-5411
Author(s):  
Dang-Bao-An Tran ◽  
Katherine M. Manfred ◽  
Robert Peverall ◽  
Grant A. D. Ritchie
Keyword(s):  
Continuous Wave ◽  
Optical Rotation ◽  
Chiral Molecules ◽  
Rotation Measurement

scholarly journals Immunochemical studies on blood groups LXII. Fractionation of hog and human A, H, and AH blood group active substance on insoluble immunoadsorbents of Dolichos and Lotus lectins.

1976 ◽  
Vol 143 (2) ◽  
pp. 422-436 ◽  
Author(s):  
M E Pereira ◽  
E A Kabat
Keyword(s):  
Blood Group ◽  
Optical Rotation ◽  
Gastric Mucin ◽  
Specific Optical Rotation ◽  
Dolichos Biflorus ◽  
Blood Group A ◽  
Analytical Properties ◽  
Group Substance ◽  
Group A

The purified lectins from Lotus tetragonolobus and Dolichos biflorus were coupled to Sepharose 2B to make insoluble adsorbents for purification and fractionation of blood group A and H active glycoproteins. With both adsorbents, hog gastric mucin A + H blood substance (HGM), purified by phenol-ethanol precipitation, yielded fractions showing only A, only H, or AH activities. The AH fraction was obtained when the adsorbent column was overloaded with HGM and its A and H specificities seem to be carried on the same molecules since they were not separable by chromatography on either column. However A and H specificities of blood group substance from the stomach of a presumably heterozygous individual hog were both on the same molecules as they too could not be fractionated on either column. Analytical properties of the isolated fractions were generally similar to those of the unfractionated material, the purfied A substances had a higher galactosamine/fucose ratio than did the H substances. Although the original A + H showed very little specific optical rotation, the separated A and H substances rotated positively and negatively, respectively. The lectin-Sepharose adsorbents have also proven useful in isolating A or H substances directly from the crude commercial hog gastric mucin. Blood group A2 substance from a human ovarian cyst yielded two fractions on the Lotus-Sepharose column; the effluent did not interact with the Lotus lectin but precipitated the Ulex and Dolichos lectins and anti-A, and appears to contain type 1 H determinants. The other fraction reacted with Lotus and Ulex lectin as well as with Dolichos and anti-A.

Identification of d- or di-∝-Tocopherol in Pharmaceuticals, Food Supplements, or Feed Supplements: A Collaborative Study

1975 ◽  
Vol 58 (3) ◽  
pp. 585-594
Author(s):  
Stanley R Ames ◽  
Emma-Jane E Drury
Keyword(s):  
Vitamin E ◽  
Oxidation Product ◽  
Optical Rotation ◽  
Collaborative Study ◽  
Food Supplements ◽  
Tocopheryl Acetate ◽  
Specific Optical Rotation ◽  
Feed Supplements ◽  
Before And After ◽  
Optical Rotations

Abstract A collaborative study was conducted to evaluate a method for identifying d- or dl-∝-tocopherol in pharmaceuticals, food supplements, or feed supplements. The sample is extracted and saponified, the extraneous color is removed by chromatography, and the sample is assayed for vitamin E. Optical rotations are determined before and after formation of the ferricyanide oxidation product. The specific optical rotation of the oxidation product is negligible for the dJ-form and +25.5° for the d-form. Statistical analysis of the data reported by 8 collaborators for the standard d-∝-tocopheryl acetate and for 6 unknown samples indicates a significant interaction between laboratories and samples. The mean coefficients of variation among laboratories for the determinations of the corrected specific optical rotation of the standard and the rotation ratio for the unknown samples containing d-∝-tocopherol were 11.7 and 21.6%, respectively, for all laboratories and 5.8 and 11.8%, respectively, for experienced laboratories. This identification test for vitamin E is acceptable for determining the form of vitamin E as either d or dl, but is not acceptable for accurately determining mixtures of the 2 forms. The method has been adopted as official first action for the identification of d- or dl-∝-tocopherol.

Temperature dependence of specific optical rotation of an aqueous levoglucosan solution

2018 ◽  
Vol 67 (11) ◽  
pp. 2155-2156
Author(s):  
A. V. Orlova ◽  
N. N. Kondakov ◽  
Yu. F. Zuev ◽  
L. O. Kononov
Keyword(s):  
Temperature Dependence ◽  
Optical Rotation ◽  
Specific Optical Rotation

Structure of the lipopolysaccharide O-chain of Yersinia enterocolitica serotype O:5,27

1987 ◽  
Vol 65 (1) ◽  
pp. 1-7 ◽  
Author(s):  
Malcolm B. Perry ◽  
Leann L. MacLean
Keyword(s):  
Nuclear Magnetic Resonance ◽  
Yersinia Enterocolitica ◽  
Lipid A ◽  
Optical Rotation ◽  
Periodate Oxidation ◽  
Partial Hydrolysis ◽  
Specific Optical Rotation ◽  
Core Oligosaccharide ◽  
Magnetic Resonance Studies ◽  
Serotype O

The cellular lipopolysaccharide produced by Yersinia enterocolitica serotype O:5,27 was of the S-type and composed of an antigenic O-chain polysaccharide linked through a core oligosaccharide region, which in turn was linked through 3-deoxy-D-manno-octulonosyl units to a lipid A moiety. The O-chain polysaccharide was composed of equal molar amounts of L-rhamnose and D-xylulose. By partial hydrolysis, periodate oxidation, methylation, specific optical rotation, and 13C and 1H nuclear magnetic resonance studies, the structure of the O-chain was established as being a linear backbone of alternating 1,3-linked α-L-rhamnopyranosyl and β-L-rhamnopyranosyl units, to which 2,2-linked β-D-threo-pent-2-ulofuranoside (D-xylulofuranoside) units were present on every L-rhamnopyranosyl residue, as shown below.[Formula: see text]

Synthesis of anisomycin. Part I. The stereospecific synthesis of N-benzoyl-2-(p-methoxybenzyl)-3-hydroxy-4-carboxamido pyrrolidine and the absolute configuration of anisomycin

1968 ◽  
Vol 46 (7) ◽  
pp. 1101-1104 ◽  
Author(s):  
C. M. Wong
Keyword(s):  
Infrared Spectra ◽  
Absolute Configuration ◽  
Optical Rotation ◽  
Specific Rotation ◽  
Stereospecific Synthesis ◽  
Specific Optical Rotation ◽  
Synthetic Compound ◽  
The Absolute ◽  
Hydrolysis Of ◽  
Absolute Stereochemistry

L-Tyrosine was converted stereospecifically to N-benzoyl-2-(p-methoxybenzyl)-3-hydroxy-4-cyanopyrrolidine (10) which had a specific optical rotation [Formula: see text]. Anisomycin was converted also to N-benzoyl-2-(p-methoxybenzyl)-3-hydroxy-4-cyanopyrrolidine (16) which had a specific rotation [Formula: see text]. The infrared spectra of the synthetic compound and the derivative of anisomycin were superimposable with each other. This result showed that the absolute configuration of the three asymmetric centers in (10) of synthetic origin were 2S, 3S, 4S, and those in (16) were 2R, 3R, 4R. Thus, anisomycin should have the absolute stereochemistry 2R, 3S, 4S as depicted in the structure (2). Hydrolysis of the hydroxy nitriles (8) and (10) gave an identical amide (3) which should have the absolute stereochemistry 2S, 3S, 4R as shown in structure (3).

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